3-bromo-5-(trifluoromethyl)pyridin-2-amine

3-bromo-5-(trifluoromethyl)pyridin-2-amine

CAS: 79456-30-7

Formula: C6H4BrF3N2

SMILES: NC1=C(Br)C=C(C=N1)C(F)(F)F

IUPAC: 3-bromo-5-(trifluoromethyl)pyridin-2-amine

InChI: InChI=1S/C6H4BrF3N2/c7-4-1-3(6(8,9)10)2-12-5(4)11/h1-2H,(H2,11,12)

Composition: C (29.90%), H (1.67%), Br (33.15%), F (23.65%), N (11.62%)

Molar Mass: 241.011

Atom Count: 16

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	239.950996
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	KBNACDZKKVMULE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.51
Topological Polar Surface Area	38.91
Polarizability	15.12
Ring Count	1
Rotatable Bond Count	1

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